Glycoside
GD134254
Name:
N-({5-[(cyclopropylcarbamoyl)methyl]-3,4-dihydroxyoxolan-2-yl}methyl)-2-methoxyacetamideFormula:
C13H22O6N2Smiles:
COCC(O)=NCC1OC(CC(O)=NC2CC2)C(O)C1OAglycone:
CC(O)=NC1CC1.CN=C(O)COCSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.85 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 7 |
| MolWt: | 302.33 | Num_heavy_atoms: | 21 |
| TPSA: | 124.1 | NumAromaticRings: | 0 |
Unique Aglycone
AD45667
Formula: C5H9ON
Smiles:
CC(O)=NC1CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 99.13 | Num_heavy_atoms: | 7 |
| TPSA: | 32.59 | NumAromaticRings: | 0 |
AD47644
Formula: C4H9O2N
Smiles:
CN=C(O)COC| HBA: | 3 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 2 |
| MolWt: | 103.12 | Num_heavy_atoms: | 7 |
| TPSA: | 41.82 | NumAromaticRings: | 0 |
